SCHEMBL8038985

SCHEMBL8038985

Cc1ccc(S(=O)(=O)S(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.68
CA1 P00915 4/20 0.62
CA2 P00918 4/20 0.62
CA12 O43570 2/20 0.62
CA9 Q16790 2/20 0.62
CA3 P07451 1/20 0.62
CA6 P23280 1/20 0.62
CA5A P35218 1/20 0.62
CA7 P43166 1/20 0.62
CA5B Q9Y2D0 1/20 0.62
TLR9 Q9NR96 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.56
ALDH1A1 P00352 4/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 2/20 0.54
MMP1 P03956 1/20 0.54
MMP2 P08253 1/20 0.54
MMP9 P14780 1/20 0.54
MMP8 P22894 1/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL547554 1.00 GAA (0.68) GAACA1CA2CA12CA9
SCHEMBL1332797 0.92 GAA (0.59) GAACA1CA2CA12CA9
SCHEMBL6363024 0.89 GAA (0.56) GAACA1CA2CA12CA9
SCHEMBL28449841 0.88 GAA (0.62) GAACA1CA2CA12CA9
SCHEMBL1060443 0.88 GAA (0.62) GAACA1CA2CA12CA9
SCHEMBL13241418 0.87 ALDH1A1 (0.62) GAACA1CA2CA12CA9
SCHEMBL14509444 0.87 ACHE (0.62) GAACA1CA2CA12CA9
SCHEMBL4848781 0.87 BCHE (0.55) GAACA1CA2CA12CA9
SCHEMBL4139519 0.86 GAA (0.59) GAACA1CA2CA12CA9
SCHEMBL664115 0.86 GAA (0.59) GAACA1CA2CA12CA9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0762207-B1 Positive working photosensitive composition and method of producing relief structures BASF AG (DE) 2000-04-12 EP disclosed
EP-0762207-A2 Positive working photosensitive composition and method of producing relief structures BASF AKTIENGESELLSCHAFT (DE) 1997-03-12 EP disclosed